N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine

C8H11F3N2 — CID 173058106

IUPACN-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine
SMILESCCNC1NC=CC=C1C(F)(F)F
InChIInChI=1S/C8H11F3N2/c1-2-12-7-6(8(9,10)11)4-3-5-13-7/h3-5,7,12-13H,2H2,1H3
InChIKeyWGJBTTQOHOQDLI-UHFFFAOYSA-N
MW192.18 g/mol
LogP1.53
Rot. Bonds2

About N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine

N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine (PubChem CID 173058106) has the molecular formula C8H11F3N2 and a molecular weight of 192.18 g/mol. Its IUPAC name is N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine
PubChem CID173058106
Molecular FormulaC8H11F3N2
Molecular Weight192.18 g/mol
Exact Mass192.09
IUPAC NameN-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine
SMILESCCNC1NC=CC=C1C(F)(F)F
InChIInChI=1S/C8H11F3N2/c1-2-12-7-6(8(9,10)11)4-3-5-13-7/h3-5,7,12-13H,2H2,1H3
InChIKeyWGJBTTQOHOQDLI-UHFFFAOYSA-N
XLogP1.53
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.18
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-Trifluoromethyl-1,2-dihydro-pyridin-2-ylamine
CID 59443902
N-ethyl-5-(trifluoromethyl)-1,2-dihydropyridin-2-amine
CID 131970485
1-(1,1,1-trifluorobutan-2-yl)-4-(trifluoromethyl)-2H-pyridin-2-amine
CID 132060250
1-(4,4,4-trifluorobutan-2-yl)-4-(trifluoromethyl)-2H-pyridin-2-amine
CID 132060253
1-(1,1,1-trifluorobutan-2-yl)-2H-pyridin-2-amine
CID 132060323
1-(4,4,4-trifluorobutan-2-yl)-2H-pyridin-2-amine
CID 132060325
N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-6-amine
CID 137468108
6-N-propan-2-yl-3-(trifluoromethyl)-1,2-dihydropyridine-5,6-diamine
CID 137468167
N-methyl-3-(trifluoromethyl)-1,2-dihydropyridin-6-amine;molecular hydrogen
CID 142135166
N-methyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine
CID 145415463
2-(2,2,2-Trifluoroethyl)-1,2,3,4-tetrahydropyrimidine
CID 174628829
2-(1,2,2-Trifluoroethyl)-1,2,3,4-tetrahydropyrimidine
CID 174628830

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine?
The IUPAC name of N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine (CID 173058106) is N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine.
What is the SMILES notation for N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine?
The canonical SMILES for N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine is CCNC1NC=CC=C1C(F)(F)F.
What is the InChIKey of N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine?
The InChIKey is WGJBTTQOHOQDLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F3N2/c1-2-12-7-6(8(9,10)11)4-3-5-13-7/h3-5,7,12-13H,2H2,1H3.
What are the key properties of N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine?
N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine has a molecular weight of 192.18 g/mol, XLogP of 1.53, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(trifluoromethyl)-1,2-dihydropyridin-2-amine is sourced from PubChem (CID 173058106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).